SCHEMBL19249696

SCHEMBL19249696

CSc1cccc(Cc2c(C)n(C/C(F)=C/CN)c3ccc(C)nc23)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 20/20 0.42
DAO P14920 2/20 0.39
AOC3 Q16853 2/20 0.39
LOX P28300 2/20 0.36
LOXL3 P58215 2/20 0.36
LOXL1 Q08397 2/20 0.36
LOXL4 Q96JB6 2/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19249867 0.88 AOC3 (0.40) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19249676 0.84 LOXL2 (0.52) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19252757 0.84 LOXL2 (0.52) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL29594816 0.84 LOXL2 (0.53) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL20915718 0.84 LOXL2 (0.53) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19249431 0.82 AOC3 (0.39) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL20915489 0.82 LOXL2 (0.62) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL20915488 0.82 LOXL2 (0.62) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL29595962 0.82 LOXL2 (0.62) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19249644 0.81 MBOAT4 (0.39) LOXL2DAOAOC3LOXLOXL3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017136871-A9 INDOLE AND AZAINDOLE HALOALLYLAMINE DERIVATIVE INHIBITORS OF LYSYL OXIDASES AND USES THEREOF PHARMAXIS LTD. (AU) 2018-02-15 WO disclosed
WO-2017136871-A1 INDOLE AND AZAINDOLE HALOALLYLAMINE DERIVATIVE INHIBITORS OF LYSYL OXIDASES AND USES THEREOF PHARMAXIS LTD. (AU) 2017-08-17 WO disclosed